Chemsrc provides Signaling Pathways's classification. They are divided into Anti-infection, Antibody-drug Conjugate, Apoptosis, Autophagy, Cell Cycle/DNA Damage, Cytoskeleton, Epigenetics, GPCR/G Protein, Immunology/Inflammation, JAK/STAT Signaling, MAPK/ERK Pathway, Membrane Transporter/Ion Channel, Metabolic Enzyme/Protease, Neuronal Signaling, NF-κB, PI3K/Akt/mTOR, PROTAC, Protein Tyrosine Kinase/RTK, Stem Cell/Wnt, TGF-beta/Smad, Vitamin D Related, Others according to their Biological activity.


Anti-infection >
Arenavirus Bacterial CMV Enterovirus Filovirus Fungal HBV HCV HIV HSV Influenza Virus Parasite Reverse Transcriptase RSV SARS-CoV
Antibody-drug Conjugate >
ADC Cytotoxin ADC Linker Drug-Linker Conjugates for ADC PROTAC-linker Conjugate for PAC
Apoptosis >
Apoptosis Bcl-2 Family c-Myc Caspase DAPK Ferroptosis IAP MDM-2/p53 PKD RIP kinase Survivin Thymidylate Synthase TNF Receptor
Autophagy >
Autophagy LRRK2 ULK Mitophagy
Cell Cycle/DNA Damage >
Antifolate APC ATM/ATR Aurora Kinase Casein Kinase CDK Checkpoint Kinase (Chk) CRISPR/Cas9 Deubiquitinase DNA Alkylator/Crosslinker DNA-PK DNA/RNA Synthesis Eukaryotic Initiation Factor (eIF) G-quadruplex Haspin Kinase HDAC HSP IRE1 Kinesin LIM Kinase (LIMK) Microtubule/Tubulin Mps1 Nucleoside Antimetabolite/Analog p97 PAK PARP PERK Polo-like Kinase (PLK) PPAR RAD51 ROCK Sirtuin SRPK Telomerase TOPK Topoisomerase Wee1
Cytoskeleton >
Arp2/3 Complex Dynamin Gap Junction Protein Integrin Kinesin Microtubule/Tubulin Mps1 Myosin PAK
Epigenetics >
AMPK Aurora Kinase DNA Methyltransferase Epigenetic Reader Domain HDAC Histone Acetyltransferase Histone Demethylase Histone Methyltransferase JAK MicroRNA PARP PKC Sirtuin Protein Arginine Deiminase
GPCR/G Protein >
5-HT Receptor Adenosine Receptor Adenylate Cyclase Adiponectin Receptor Adrenergic Receptor Angiotensin Receptor Bombesin Receptor Bradykinin Receptor Cannabinoid Receptor CaSR CCR CGRP Receptor Cholecystokinin Receptor CRFR CXCR Dopamine Receptor EBI2/GPR183 Endothelin Receptor GHSR Glucagon Receptor Glucocorticoid Receptor GNRH Receptor GPCR19 GPR109A GPR119 GPR120 GPR139 GPR40 GPR55 GPR84 Guanylate Cyclase Histamine Receptor Imidazoline Receptor Leukotriene Receptor LPL Receptor mAChR MCHR1 (GPR24) Melatonin Receptor mGluR Motilin Receptor Neurokinin Receptor Neuropeptide Y Receptor Neurotensin Receptor Opioid Receptor Orexin Receptor (OX Receptor) Oxytocin Receptor P2Y Receptor Prostaglandin Receptor Protease-Activated Receptor (PAR) Ras RGS Protein Sigma Receptor Somatostatin Receptor TSH Receptor Urotensin Receptor Vasopressin Receptor Melanocortin Receptor
Immunology/Inflammation >
Aryl Hydrocarbon Receptor CCR Complement System COX CXCR FLAP Histamine Receptor IFNAR Interleukin Related IRAK MyD88 NO Synthase NOD-like Receptor (NLR) PD-1/PD-L1 PGE synthase Salt-inducible Kinase (SIK) SPHK STING Thrombopoietin Receptor Toll-like Receptor (TLR) Arginase
JAK/STAT Signaling >
EGFR JAK Pim STAT
MAPK/ERK Pathway >
ERK JNK KLF MAP3K MAP4K MAPKAPK2 (MK2) MEK Mixed Lineage Kinase MNK p38 MAPK Raf Ribosomal S6 Kinase (RSK)
Membrane Transporter/Ion Channel >
ATP Synthase BCRP Calcium Channel CFTR Chloride Channel CRAC Channel CRM1 EAAT2 GABA Receptor GlyT HCN Channel iGluR Monoamine Transporter Monocarboxylate Transporter Na+/Ca2+ Exchanger Na+/HCO3- Cotransporter Na+/K+ ATPase nAChR NKCC P-glycoprotein P2X Receptor Potassium Channel Proton Pump SGLT Sodium Channel TRP Channel URAT1
Metabolic Enzyme/Protease >
15-PGDH 5 alpha Reductase 5-Lipoxygenase Acetyl-CoA Carboxylase Acyltransferase Adenosine Deaminase Adenosine Kinase Aldehyde Dehydrogenase (ALDH) Aldose Reductase Aminopeptidase Angiotensin-converting Enzyme (ACE) ATGL ATP Citrate Lyase Carbonic Anhydrase Carboxypeptidase Cathepsin CETP COMT Cytochrome P450 Dipeptidyl Peptidase Dopamine β-hydroxylase E1/E2/E3 Enzyme Elastase Enolase FAAH FABP Factor Xa Farnesyl Transferase Fatty Acid Synthase (FAS) FXR Glucokinase GSNOR Gutathione S-transferase HCV Protease Hexokinase HIF/HIF Prolyl-Hydroxylase HIV Integrase HIV Protease HMG-CoA Reductase (HMGCR) HSP Indoleamine 2,3-Dioxygenase (IDO) Isocitrate Dehydrogenase (IDH) Lactate Dehydrogenase LXR MAGL Mineralocorticoid Receptor Mitochondrial Metabolism MMP Nampt NEDD8-activating Enzyme Neprilysin PAI-1 PDHK PGC-1α Phosphatase Phosphodiesterase (PDE) Phospholipase Procollagen C Proteinase Proteasome Pyruvate Kinase RAR/RXR Renin ROR Ser/Thr Protease SGK Stearoyl-CoA Desaturase (SCD) Thrombin Tryptophan Hydroxylase Tyrosinase Xanthine Oxidase
Neuronal Signaling >
5-HT Receptor AChE Adenosine Kinase Amyloid-β Beta-secretase CaMK CGRP Receptor COMT Dopamine Receptor Dopamine Transporter FAAH GABA Receptor GlyT iGluR Imidazoline Receptor mAChR Melatonin Receptor Monoamine Oxidase nAChR Neurokinin Receptor Opioid Receptor Serotonin Transporter γ-secretase
NF-κB >
NF-κB IKK Keap1-Nrf2 MALT1
PI3K/Akt/mTOR >
Akt AMPK ATM/ATR DNA-PK GSK-3 MELK mTOR PDK-1 PI3K PI4K PIKfyve PTEN
PROTAC >
PROTAC E3 Ligase Ligand-Linker Conjugate Ligand for E3 Ligase PROTAC Linker PROTAC-linker Conjugate for PAC
Protein Tyrosine Kinase/RTK >
Ack1 ALK Bcr-Abl BMX Kinase Btk c-Fms c-Kit c-Met/HGFR Discoidin Domain Receptor DYRK EGFR Ephrin Receptor FAK FGFR FLT3 IGF-1R Insulin Receptor IRAK Itk PDGFR PKA Pyk2 ROS Src Syk TAM Receptor Trk Receptor VEGFR
Stem Cell/Wnt >
Casein Kinase ERK Gli GSK-3 Hedgehog Hippo (MST) JAK Notch Oct3/4 PKA Porcupine ROCK sFRP-1 Smo STAT TGF-beta/Smad Wnt YAP β-catenin γ-secretase
TGF-beta/Smad >
TGF-beta/Smad PKC ROCK TGF-β Receptor
Vitamin D Related >
VD/VDR
Others >
Androgen Receptor Aromatase Estrogen Receptor/ERR Progesterone Receptor Thyroid Hormone Receptor Others

iBRD4-BD1

iBRD4-BD1 is selective BRD4 bromodomain inhibitor. iBRD4-BD1 has inhibition activity for BRD4 bromodomain with an IC50 value of 12 nM. iBRD4-BD1 can be used for the research of inflammation and oncology[1].

  • CAS Number: 2839318-17-9
  • MF: C29H30F3N5O
  • MW: 521.58
  • Catalog: Epigenetic Reader Domain
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

N-Hydroxypipecolic acid potassium

N-Hydroxypipecolic acid potassium (1-Hydroxy-2-piperidinecarboxylic acid potassium), a plant metabolite and a systemic acquired resistance (SAR) regulator, orchestrates SAR establishment in concert with the immune signal salicylic acid. N-Hydroxypipecolic acid potassium accumulates systemically in the plant foliage in response to pathogen attack. N-Hydroxypipecolic acid potassium induces SAR to bacterial and oomycete infection[1][2][3].

  • CAS Number: 2253632-01-6
  • MF: C6H10KNO3
  • MW: 183.25
  • Catalog: Inflammation/Immunology
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

2,3,5,6-Tetramethoxyaporphine

2,3,5,6-Tetramethoxyaporphine is an antitussive agent, a medicinally valuable benzyl isoquinoline alkaloid. 2,3,5,6-Tetramethoxyaporphine can be isolated from the yellow hornpoppy, Glaucium flavum Cr. (Fam. Papaveraceae)[1][2].

  • CAS Number: 5630-11-5
  • MF: C21H25NO4
  • MW: 355.42800
  • Catalog: Others
  • Density: 1.166g/cm3
  • Boiling Point: 487ºC at 760 mmHg
  • Melting Point: 119ºC
  • Flash Point: 140.2ºC

1H-1-Ethyl Candesartan Cilexetil

1H-1-Ethyl Candesartan Cilexetil is a potential impurity found in bulk preparations of Candesartan Cilexetil (HY-17505).

  • CAS Number: 914613-35-7
  • MF: C35H38N6O6
  • MW: 638.71300
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Tedizolid

Tedizolid is a novel oxazolidinone, acting through inhibition of bacterial protein synthesis by binding to 23S ribosomal RNA (rRNA) of the 50S subunit of the ribosome.

  • CAS Number: 856866-72-3
  • MF: C17H15FN6O3
  • MW: 370.338
  • Catalog: Bacterial
  • Density: 1.6±0.1 g/cm3
  • Boiling Point: 614.5±65.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 325.4±34.3 °C

Epacadostat(INCB024360)

Epacadostat (INCB 024360) is a potent and selective indoleamine 2,3-dioxigenase 1 (IDO1) inhibitor with an IC50 of 71.8 nM.

  • CAS Number: 1204669-58-8
  • MF: C11H13BrFN7O4S
  • MW: 438.233
  • Catalog: Indoleamine 2,3-Dioxygenase (IDO)
  • Density: 2.0±0.1 g/cm3
  • Boiling Point: 672.3±65.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 360.4±34.3 °C

5'-O-DMT-2'-O-TBDMS-rI

5'-O-DMT-2'-O-TBDMS-rI is a modified nucleoside. 5'-O-DMT-2'-O-TBDMS-rI can be used in the synthesis of deoxyribonucleic acid or nucleic acid.

  • CAS Number: 127212-34-4
  • MF: C37H44N4O7Si
  • MW: 684.85
  • Catalog: DNA/RNA Synthesis
  • Density: 1.24±0.1 g/cm3
  • Boiling Point: 831.1±65.0 °C
  • Melting Point: N/A
  • Flash Point: N/A

6-hydroxyapigenin-6-O-β-D-glucoside-7-O-β-D-glucuronide

6-Hydroxyapigenin 6-O-β-D-glucoside-7-O-β-D-glucuronide (compound 8) is a kind of flavonoid. 6-Hydroxyapigenin 6-O-β-D-glucoside-7-O-β-D-glucuronide can be isolated from the water extract of Carthamus tinctorius[1].

  • CAS Number: 1146045-40-0
  • MF: C27H28O17
  • MW: 624.50
  • Catalog: Others
  • Density: 1.8±0.1 g/cm3
  • Boiling Point: 1040.3±65.0 °C at 760 mmHg
  • Melting Point: 254-256 °C
  • Flash Point: 343.6±27.8 °C

Varenicline (Hydrochloride)

Varenicline Hcl(CP 526555;Champix) is a nicotinic receptor partial agonist; it stimulates nicotine receptors more weakly than nicotine itself does.IC50 value:Target: nAChRVarenicline(CP 526555; Champix; Chantix) is a prescription medication used to treat smoking addiction. As a partial agonist it both reduces cravings for and decreases the pleasurable effects of cigarettes and other tobacco products. Through these mechanisms Varenicline(CP 526555; Champix; Chantix) can assist some patients to quit smoking.

  • CAS Number: 230615-23-3
  • MF: C13H14ClN3
  • MW: 247.723
  • Catalog: nAChR
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

TA-7552

TA-7552 is a potent cholesterol-lowering agent.

  • CAS Number: 104756-72-1
  • MF: C25H26O10
  • MW: 486.46800
  • Catalog: Cardiovascular Disease
  • Density: 1.269g/cm3
  • Boiling Point: 592.3ºC at 760mmHg
  • Melting Point: N/A
  • Flash Point: 195ºC

Topoisomerase II inhibitor 15

Topoisomerase II inhibitor 15 (compound 2g) is a Topoisomerase II inhibitor. Topoisomerase II inhibitor 15 potently is an apoptotic inducer with greater selectivity against head and neck tumors[1].

  • CAS Number: 451516-79-3
  • MF: C15H11Cl2N5
  • MW: 332.19
  • Catalog: Apoptosis
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

ABBV-167

ABBV-167 is a phosphate prodrug of the BCL-2 inhibitor venetoclax.

  • CAS Number: 1351456-78-4
  • MF: C46H53ClN7O11PS
  • MW: 978.45
  • Catalog: Bcl-2 Family
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Taurolidine

Taurolidine is a broad-spectrum antimicrobial for the prevention of central venous catheter-related infections. Taurolidine has a direct and selective antineoplastic effect on brain tumor cells by the induction of apoptosis[1].

  • CAS Number: 19388-87-5
  • MF: C7H16N4O4S2
  • MW: 284.356
  • Catalog: Bacterial
  • Density: 1.5±0.1 g/cm3
  • Boiling Point: 471.2±55.0 °C at 760 mmHg
  • Melting Point: 156ºC
  • Flash Point: 238.8±31.5 °C

(2S)-Gemcitabine-13C,15N2 hydrochloride

(2S)-Gemcitabine-13C,15N2 (hydrochloride) is the 13C and 15N labeled (2S)-Gemcitabine hydrochloride[1].

  • CAS Number: 1262897-74-4
  • MF: C813CH12ClF2N15N2O4
  • MW: 302.639
  • Catalog: Others
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

TRPV4 antagonist 3

TRPV4 antagonist 3 is a TRPV4 antagonist (pIC50 = 8.4).

  • CAS Number: 2681273-35-6
  • MF: C20H18F4N4O3S
  • MW: 470.44
  • Catalog: TRP Channel
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Leucocrystal violet

Leucocrystal violet is a triphenylmethane dye which can be used to detect antimony in environmental and biological samples using spectrophotometric techniques.

  • CAS Number: 603-48-5
  • MF: C25H31N3
  • MW: 373.534
  • Catalog: Dye Reagents
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 529.8±50.0 °C at 760 mmHg
  • Melting Point: 175-177 °C(lit.)
  • Flash Point: 281.8±20.7 °C

PF-4693627

PF-4693627 is a potent, selective and orally bioavailable microsomal prostaglandin E synthase-1 (mPGES-1) inhibitor (IC50=3 nM) for the treatment of inflammation caused by osteoarthritis (OA) and rheumatoid arthritis (RA)[1].

  • CAS Number: 1312815-93-2
  • MF: C26H29Cl2N3O3
  • MW: 502.433
  • Catalog: PGE synthase
  • Density: 1.4±0.1 g/cm3
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

L-817,818

L-817818 is a potent and subtype-selective agonist of the somatostatin receptor. L-817818 provides a direct approach to defining somatostatin receptor physiological functions[1]

  • CAS Number: 217480-27-8
  • MF: C33H36N4O3
  • MW: 536.66400
  • Catalog: Somatostatin Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

BI8626

BI8626 is a specific inhibitor of the ubiquitin ligase HUWE1 with an IC50 of 0.9 μM[1].

  • CAS Number: 1875036-75-1
  • MF: C25H28N8
  • MW: 440.54
  • Catalog: E1/E2/E3 Enzyme
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

Bemegride

Bemegride is a central nervous system stimulant and antidote for barbiturate poisoning.target: GABAA receptor Bemegride has an antagonistic action on the GABAA receptor, suppressing both GABA- and pentobarbitone-evoked whole-cell currents to similar extents. [1] Long-term oral administration to the rat of barbitone, alone or together with the analeptics bemegride or pentylenetetrazol, show that the intensity of the withdrawal syndrome generally parallels the degree of associated CNS depression. [2]

  • CAS Number: 64-65-3
  • MF: C8H13NO2
  • MW: 155.194
  • Catalog: GABA Receptor
  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 282.0±9.0 °C at 760 mmHg
  • Melting Point: 126-127 °C(lit.)
  • Flash Point: 125.8±18.9 °C

Thalidomide-4-NH-PEG1-COO(t-Bu)

Thalidomide-4-NH-PEG1-COO(t-Bu) is a t-Bu modified Thalidomide (HY-14658), which acts as a Cereblon ligand to recruit CRBN protein. The t-Bu protecting group at the end of Thalidomide-4-NH-PEG1-COO(t-Bu) can be removed under acidic conditions to participate in the synthesis of PROTAC molecules. Thalidomide-4-NH-PEG1-COO(t-Bu) is a key intermediate in the synthesis of CRBN-based PROTAC molecules.

  • CAS Number: 2140807-19-6
  • MF: C22H27N3O7
  • MW: 445.47
  • Catalog: Ligand for E3 Ligase
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

PA (224-233), Influenza

PA (224-233), Influenza is a 10-aa peptide, a fragment of polymerase 2 protein in influenza A virus.

  • CAS Number: 271573-27-4
  • MF: C53H80N14O17
  • MW: 1185.29
  • Catalog: Peptides
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

metolachlor [ANSI, WSSA]

Metolachlor is a pre-emergent selective, chloroacetanilide herbicide for the control of a variety of annual grass and broad leaf weeds in corn and other crops. Metolachlor is a chiral herbicide consisting of four stereoisomers[1][2].

  • CAS Number: 51218-45-2
  • MF: C15H22ClNO2
  • MW: 283.794
  • Catalog: Others
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 406.8±45.0 °C at 760 mmHg
  • Melting Point: -62.1 °C
  • Flash Point: 199.8±28.7 °C

3,4'-Dihydroxy-3',5,7-trimethoxyflavan

5,7,3' -tri-O-Methyl (-)-epicatechin (Compound 13) is a phospholipase Cγ1 (PLCγ1) inhibitor. 5,7,3' -tri-o-methyl (-)-epicatechin has a methylene dioxy benzene ring and can express inhibitory activity against PLCγ1. 5,7,3' -tri-O-Methyl (-)-epicatechin can be used in the study of chemotherapy and chemopexic agents for cancer [1].

  • CAS Number: 97914-19-7
  • MF: C18H20O6
  • MW: 332.35
  • Catalog: Cancer
  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 541.1±50.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 281.0±30.1 °C

Atorvastatin Sodium

Atorvastatin sodium is an orally active HMG-CoA reductase inhibitor, has the ability to effectively decrease blood lipids. Atorvastatin sodium inhibits human SV-SMC proliferation and invasion with IC50s of 0.39 μM and 2.39 μM, respectively[1][2][3][4][5].

  • CAS Number: 134523-01-6
  • MF: C33H34FN2NaO5
  • MW: 580.62
  • Catalog: Autophagy
  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 722.2±60.0ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 390.6±32.9ºC

Propargyl-PEG1-SS-PEG1-C2-Boc

Propargyl-PEG1-SS-PEG1-C2-Boc is a cleavable ADC linker used in the synthesis of antibody-drug conjugates (ADCs)[1].

  • CAS Number: 1807518-78-0
  • MF: C14H24O4S2
  • MW: 320.468
  • Catalog: ADC Linker
  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 407.4±40.0 °C at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 187.0±15.4 °C

HHS-0701

HHS-0701, a sulfur-triazole exchange (SuTEx) ligand, is a potent tyrosine-reactive prostaglandin reductase 2 (PTGR2) inhibitor. HHS-0701 blocks PTGR2 metabolism of the lipid substrate 15-Keto-PGE2[1].

  • CAS Number: 2851993-91-2
  • MF: C20H20N4O3S
  • MW: 396.46
  • Catalog: Prostaglandin Receptor
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A

chromium protoporphyrin IX

Cr(III) protoporphyrin IX is a protoporphyrin IX. Protoporphyrin IX is a heterocyclic organic compound, which consists of four pyrrole rings, and is the final intermediate in the heme biosynthetic pathway[1].

  • CAS Number: 84640-43-7
  • MF: C34H31CrN4O4
  • MW: 611.63000
  • Catalog: Others
  • Density: N/A
  • Boiling Point: 1128.5ºC at 760 mmHg
  • Melting Point: N/A
  • Flash Point: 636.3ºC

Sarcosine hydrochloride

2-(Methylamino)acetic acid hydrochloride is a Glycine (HY-Y0966) derivative[1].

  • CAS Number: 637-96-7
  • MF: C3H8ClNO2
  • MW: 125.554
  • Catalog: Others
  • Density: 1.48 g/cm3
  • Boiling Point: 195.1ºC at 760 mmHg
  • Melting Point: 173-175 °C(lit.)
  • Flash Point: 71.8ºC

PROTAC IRAK4 degrader-1

PROTAC IRAK4 degrader-1 is a PROTAC interleukin-1 receptor-associated kinase 4 (IRAK4) degrader extracted from patent US20190192668A1 Compound I-210, makes <20%, >20-50%, and >50% IRAK4 degradation at 0.01, 0.1, and 1 μM in OCI-LY-10 cells, respectively[1].

  • CAS Number: 2360533-90-8
  • MF: C44H39F3N12O7
  • MW: 904.85
  • Catalog: IRAK
  • Density: N/A
  • Boiling Point: N/A
  • Melting Point: N/A
  • Flash Point: N/A